| SpectraBase Spectrum ID |
8wEBfkW4kDL |
| Name |
(1S,5S,6R,7R)-3-(3-Carboxybenzyl)-7-hydroxy-6-[(E,S)-3-hydroxy-1-octenyl]bicyclo[3.3.0]-2-octene |
| Alternate Name(s) |
3-({(3aS,5R,6R,6aS)-5-hydroxy-6-[(1E,3S)-3-hydroxy-1-octenyl]-1,3a,4,5,6,6a-hexahydro-2-pentalenyl}methyl)benzoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H32O4 |
| InChI |
InChI=1S/C24H32O4/c1-2-3-4-8-20(25)9-10-21-22-14-17(13-19(22)15-23(21)26)11-16-6-5-7-18(12-16)24(27)28/h5-7,9-10,12-13,19-23,25-26H,2-4,8,11,14-15H2,1H3,(H,27,28)/b10-9+/t19-,20-,21+,22-,23+/m0/s1 |
| InChIKey |
JQBKVDHJRKJHQZ-RNJUVHPUSA-N |
| Molecular Weight |
384.516 g/mol |
| SMILES |
O[C@](\C=C\[C@@]1([C@@]2([C@](C[C@]1(O)[H])(C=C(C2)Cc1cc(C(=O)O)ccc1)[H])[H])[H])(CCCCC)[H] |
| SPLASH |
splash10-00ku-7903000000-0d13b21b75ec4c94b675 |
| Source of Spectrum |
F-51-5540-10 |
| Wiley ID |
791931 |
![(1S,5S,6R,7R)-3-(3-Carboxybenzyl)-7-hydroxy-6-[(E,S)-3-hydroxy-1-octenyl]bicyclo[3.3.0]-2-octene](/api/spectrum/8wEBfkW4kDL/structure.png?h=300&w=458 "(1S,5S,6R,7R)-3-(3-Carboxybenzyl)-7-hydroxy-6-[(E,S)-3-hydroxy-1-octenyl]bicyclo[3.3.0]-2-octene")
